N-[3-chloranyl-4-(2-oxidanylidenechromen-3-yl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[3-chloranyl-4-(2-oxidanylidenechromen-3-yl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitro-benzamide Openeye Name: N-[3-chloro-4-(2-oxochromen-3-yl)phenyl]-4-(4-methyl-1-piperidyl)-3-nitro-benzamide CAS Name: N-[3-chloro-4-(2-oxo-1-benzopyran-3-yl)phenyl]-4-(4-methyl-1-piperidinyl)-3-nitrobenzamide IUPAC Name: N-[3-chloro-4-(2-oxochromen-3-yl)phenyl]-4-(4-methylpiperidin-1-yl)-3-nitrobenzamide Traditional Name: N-[3-chloro-4-(2-ketochromen-3-yl)phenyl]-4-(4-methylpiperidino)-3-nitro-benzamide Formula: C28H24ClN3O5 MolecularWeight: 517.96026

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)C4=CC5=CC=CC=C5OC4=O)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC(=C(C=C3)C4=CC5=CC=CC=C5OC4=O)Cl)[N+](=O)[O-]

InChI

InChI=1S/C28H24ClN3O5/c1-17-10-12-31(13-11-17)24-9-6-19(15-25(24)32(35)36)27(33)30-20-7-8-21(23(29)16-20)22-14-18-4-2-3-5-26(18)37-28(22)34/h2-9,14-17H,10-13H2,1H3,(H,30,33)